Summary

IMPPAT Phytochemical identifier: IMPHY008825

Phytochemical name: 24-Methyl-31-norlanost-9(11)-enol

Synonymous chemical names:
24-methyl-31-norlanost-9(11)-enol

Chemical structure information

SMILES:
CC(C(CCC(C1CCC2(C1(C)CC=C1C2CCC2C1(C)CCC(C2C)O)C)C)C)C

InChI:
InChI=1S/C30H52O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h14,19-24,26-27,31H,9-13,15-18H2,1-8H3

InChIKey:
NWPXYRKVJLBSQU-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCC5C)CC=CC6CCCC6C)CCCC6C))O)))))))))))))C)))))C))))C))C

Functional groups:
CC=C(C)C, CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=C2C3CCCCC3CCC2C2CCCC2C1

Scaffold Graph/Node level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

Scaffold Graph level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Steroids and steroid derivatives

ClassyFire Subclass: Ergostane steroids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Steroids

NP Classifier Class: Ergostane steroids

NP-Likeness score: 3.213

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Chemical structure download